General Information of the Compound
| Compound ID |
CP0188736
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[4-amino-7-(cyclopenten-1-yl)-3H-imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H23N5O
|
||||||||||||||||||
| Molecular Weight |
349.438
|
||||||||||||||||||
| Canonical SMILES |
CCN(Cc1nc2c(N)nc3cc(ccc3c2[nH]1)C1=CCCC1)C(C)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H23N5O/c1-3-25(12(2)26)11-17-23-18-15-9-8-14(13-6-4-5-7-13)10-16(15)22-20(21)19(18)24-17/h6,8-10H,3-5,7,11H2,1-2H3,(H2,21,22)(H,23,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
MLTFIKCMNRDFLD-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT02160, Toll-like receptor 7
Protein ID: PT02546, Toll-like receptor 8